aldehyde C-10, decanal

SMILES:
CCCCCCCCCC=O

Aroma Description:
sweet, aldehydic, waxy, orange_peel, citrus, floral1

Receptor log10 EC50 Adj. Top Antagonist? Correlated Perceptual Qualities
OR56A4 -3.41 2, -1.84 4, -4.41 10 3.1751 2, 2.6667 4  cloth, laundered, orange_peel, aldehydic
VN1R3 - 10 7  orange_peel, aldehydic
VN1R5 - 8 7  tart, orange_peel, aldehydic, spearmint, caraway, waxy, citrus, blueberry, rose, orange
OR1A2 - 5.5 11  citrus, orange_peel, aldehydic, melon, waxy, ozone, orange, lime
OR4N5 -2.84 2 0.7145 2  (insufficient data)
OR1G1 - 3.1472 3  waxy, tart, orange, sweet, aldehydic, fresh, citrus, clean, medicinal, anise
OR52D1 - 2.9949 3  anise, cheesy, orange, sweet, dairy, sour, rancid, waxy, tart, sharp
OR52I2 -2.66 2 0.2141 2  milky, lactonic, dairy, peach, coconut, creamy
OR1A1 - -1.6 4, 0 6, 4 11  herbal, caraway, passionfruit, spearmint, weedy, orange, hay, fresh, waxy, citrus
VN1R1 - 0.8 7, 0.3333 8  grapefruit, lemon, lactonic, natural, jasmine, tropical, oily
OR7D4 - 0.1 5  animal
OR10G3 - 0.0167 4  vanilla, chocolate, creamy
OR10J5 - 0 4, 0 6   
OR11A1 - 0 4   
OR1C1 - 0 4   
OR2A25 - 0 4   
OR2B11 - 0 4   
OR2J2 - 0 4, 0 6   
OR2J3 - 0 4   
OR2W1 - 0 4, 0 6   
OR51E1 - 0 4, 0 6   
OR51L1 - 0 4, 0 6   
OR5K1 - 0 4   
OR8K3 - 0 4   
OR2C1 - 0 6   
OR5A1 - 0 9   
OR5AN1 - 0 9   
OR8D1 - -0.04 4   
OR10G7 - -0.0667 4   
OR5P3 - -2.6667 4, 0 6   
 

aldehyde C-10, decanal

SMILES:
CCCCCCCCCC=O

Aroma Description:
sweet, aldehydic, waxy, orange_peel, citrus, floral

Receptor Dock Score Affinity A100 Correlated Perceptual Qualities

Dock Score: This is a measure of whether the algorithm thinks the odorant is an agonist of the receptor.
Affinity: The binding affinity, in kJ/mol, of the ligand docked in the active or inactive model, whichever is greater.
A100: A measure of the degree of activation of the receptor. See Ibrahim et al (2019).

1.) The Good Scents Company

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4.) Adipietro KA, Mainland JD, Matsunami H (2012) Functional Evolution of Mammalian Odorant Receptors. PLoS Genet 8(7): e1002821. doi:10.1371/ journal.pgen.1002821

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8.) I. Wallrabenstein, J. Gerber, S. Rasche, I. Croy, S. Kurtenbach, T. Hummel, H. Hatt, The smelling of Hedione results in sex-differentiated human brain activity, NeuroImage, Volume 113, 2015, Pages 365-373, ISSN 1053-8119

9.) Keiichi Yoshikawa, Jun Deguchi, Hu Jieying et al. Diverse yet selective tuning of an odorant receptor for sensing four classes of musk compounds, 03 August 2022, PREPRINT (Version 1) available at Research Square [https://doi.org/10.21203/rs.3.rs-1916850/v1]

10.) Dunkel, A.; Steinhaus, M.; Kotthoff, M.; Nowak, B.; Krautwurst, D.; Schieberle, P.; Hofmann, T. Nature’s chemical signatures in human olfaction: A foodborne perspective for future biotechnology. Angew. Chem. Int. Ed. Engl. 2014, 53, 7124–7143.

11.) Schmiedeberg K, Shirokova E, Weber HP, Schilling B, Meyerhof W, Krautwurst D. Structural determinants of odorant recognition by the human olfactory receptors OR1A1 and OR1A2. J Struct Biol. 2007 Sep;159(3):400-12. doi: 10.1016/j.jsb.2007.04.013. Epub 2007 May 25. PMID: 17601748.